| CAS Number | 191105-37-0 |
| Catalog Number | AG00ACW6(AGN-PC-0435Y5) |
| Chemical Name | 2-Amino-4-ethyl-1,3-thiazole-5-carboxylic acid |
| IUPAC Name | 2-amino-4-ethyl-1,3-thiazole-5-carboxylic acid |
| InChI | InChI=1S/C6H8N2O2S/c1-2-3-4(5(9)10)11-6(7)8-3/h2H2,1H3,(H2,7,8)(H,9,10) |
| InChI Key | OHUPJQLYQCVDHP-UHFFFAOYSA-N |
| MDL Number | MFCD13188627 |
| Molecular Formula | C6H8N2O2S |
| Molecular Weight | 172.2049 |
| SMILES | CCC1=C(C(O)=O)SC(N)=N1 |
| Synonyms | 191105-37-0,
2-AMINO-4-ETHYL-1,3-THIAZOLE-5-CARBOXYLIC ACID,
2-Amino-4-ethylthiazole-5-carboxylic acid,
SCHEMBL1539908,
DTXSID10634072,
MFCD13188627,
ZINC42384191,
AKOS006335044,
MCULE-4261415359,
AJ-104352,
5-Thiazolecarboxylic acid, 2-amino-4-ethyl-,
Y-7404,
Z1492781257,
2-amino-4-ethyl-1,3-thiazole-5-carboxylic acid(SALTDATA,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.202g/mol |
| Monoisotopic Mass | 172.031g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 104A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number